CID 51060951

N'-(2-methyl-3-phenyl-2-propenylidene)-2-(2-nitrophenoxy)propanohydrazide

Structural Information

Molecular Formula
C19H19N3O4
SMILES
CC(C(=O)N/N=C/C(=C\C1=CC=CC=C1)/C)OC2=CC=CC=C2[N+](=O)[O-]
InChI
InChI=1S/C19H19N3O4/c1-14(12-16-8-4-3-5-9-16)13-20-21-19(23)15(2)26-18-11-7-6-10-17(18)22(24)25/h3-13,15H,1-2H3,(H,21,23)/b14-12-,20-13+
InChIKey
ZHYGRGLMTRVDEC-RUKGVYQZSA-N
Compound name
N-[(E)-[(Z)-2-methyl-3-phenylprop-2-enylidene]amino]-2-(2-nitrophenoxy)propanamide
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

353.13754 Da
Monoisotopic Mass

3.9
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 354.14482 183.3
[M+Na]+ 376.12676 185.4
[M-H]- 352.13026 190.3
[M+NH4]+ 371.17136 194.3
[M+K]+ 392.10070 178.6
[M+H-H2O]+ 336.13480 178.2
[M+HCOO]- 398.13574 208.3
[M+CH3COO]- 412.15139 213.5
[M+Na-2H]- 374.11221 186.9
[M]+ 353.13699 182.0
[M]- 353.13809 182.0
m/z: mass to charge ratio of the adduct.
Predicted Collision Cross Section (CCS) values (Ų) per adduct calculated using CCSbase.

Literature stripe

No literature data available for this compound.

Patent stripe

No patent data available for this compound.